Reaction Details Report a problem with these data
Target
Neuronal acetylcholine receptor subunit alpha-7
Ligand
BDBM165935
Substrate
n/a
Meas. Tech.
The [3H]-methyllycaconitine binding assay
Ki
3.00±n/a nM
Citation
 Luithle, J; Böβ, F; Erb, C; Hafner, F; Schnizler, K; Flessner, T; Van Kampen, M; Van Der Staay, F 2-heteroaryl carboxamides US Patent  US10214524 Publication Date 2/26/2019 
Target
Name:
Neuronal acetylcholine receptor subunit alpha-7
Synonyms:
ACHA7_RAT | Acra7 | Cholinergic, Nicotinic Alpha7 | Cholinergic, Nicotinic Alpha7/5-HT3 | Chrna7 | Neuronal acetylcholine receptor | Neuronal acetylcholine receptor (alpha7 nAChR) | Neuronal acetylcholine receptor subunit alpha 7 | Neuronal acetylcholine receptor subunit alpha-7 | Neuronal acetylcholine receptor subunit alpha-7 (nAChR alpha7) | Neuronal acetylcholine receptor subunit alpha-7 (nAChR)
Type:
Enzyme
Mol. Mass.:
56502.44
Organism:
Rattus norvegicus (Rat)
Description:
Q05941
Residue:
502
Sequence:
MCGGRGGIWLALAAALLHVSLQGEFQRRLYKELVKNYNPLERPVANDSQPLTVYFSLSLLQIMDVDEKNQVLTTNIWLQMSWTDHYLQWNMSEYPGVKNVRFPDGQIWKPDILLYNSADERFDATFHTNVLVNASGHCQYLPPGIFKSSCYIDVRWFPFDVQQCKLKFGSWSYGGWSLDLQMQEADISSYIPNGEWDLMGIPGKRNEKFYECCKEPYPDVTYTVTMRRRTLYYGLNLLIPCVLISALALLVFLLPADSGEKISLGITVLLSLTVFMLLVAEIMPATSDSVPLIAQYFASTMIIVGLSVVVTVIVLRYHHHDPDGGKMPKWTRIILLNWCAWFLRMKRPGEDKVRPACQHKPRRCSLASVELSAGAGPPTSNGNLLYIGFRGLEGMHCAPTPDSGVVCGRLACSPTHDEHLMHGAHPSDGDPDLAKILEEVRYIANRFRCQDESEVICSEWKFAACVVDRLCLMAFSVFTIICTIGILMSAPNFVEAVSKDFA
  
Inhibitor
Name:
BDBM165935
Synonyms:
US10214524, Example 154 | US9067931, 154
Type:
Small organic molecule
Emp. Form.:
C26H27N3O3
Mol. Mass.:
429.5109
SMILES:
O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(-c3cccc(c3)C(=O)NC3CC3)c2o1 |r,wU:3.2,(-4.12,-1.78,;-4.12,-.24,;-5.45,.53,;-6.79,-.24,;-6.79,-1.78,;-8.12,-2.55,;-9.45,-1.78,;-9.45,-.24,;-8.12,.53,;-7.46,-.73,;-8.89,-1.17,;-2.79,.53,;-2.63,2.07,;-1.12,2.39,;-.35,3.72,;1.19,3.72,;1.96,2.39,;1.19,1.05,;1.96,-.28,;1.19,-1.62,;1.96,-2.95,;3.5,-2.95,;4.27,-1.62,;3.5,-.28,;5.81,-1.62,;6.58,-.28,;6.58,-2.95,;8.12,-2.95,;9.45,-3.72,;9.45,-2.18,;-.35,1.05,;-1.38,-.09,)|
Structure:
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